SCHEMBL14766941

SCHEMBL14766941

C=CCCOc1ccc(COC2CCC(c3ccc(C4CCC(OCC)CC4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.33
HTR6 P50406 1/20 0.32
HTR1A P08908 1/20 0.31
ACACA Q13085 1/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
ALOX5AP P20292 1/20 0.30
FEN1 P39748 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14766164 0.94 HTR1A (0.30) HTR1A
SCHEMBL14766668 0.93 CRBN (0.33) NAAAHTR6HTR1AACACA
SCHEMBL12740286 0.93 HTR6 (0.32) NAAAHTR6HTR1AACACAMAOA
SCHEMBL14766602 0.91 FFAR4 (0.36) NAAAHTR6ACACAALOX5APFEN1
SCHEMBL14766918 0.90 CRBN (0.33) NAAAHTR6HTR1A
SCHEMBL14766870 0.90 FFAR4 (0.35) NAAAACACAALOX5APFEN1
SCHEMBL14767034 0.90 HTR2A (0.35) NAAAHTR6HTR1AACACAMAOA
SCHEMBL14766448 0.89 FFAR1 (0.31) ACACA
SCHEMBL14767254 0.89 FFAR4 (0.34) NAAAALOX5APFEN1
SCHEMBL12740287 0.89 HTR6 (0.32) NAAAHTR6HTR1AMAOAMAOB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed